methyl 2-[[4-(prop-2-ynylamino)-2-(trifluoromethyl)phenyl]sulfonylamino]ethanoate

Systemtic Name: methyl 2-[[4-(prop-2-ynylamino)-2-(trifluoromethyl)phenyl]sulfonylamino]ethanoate Openeye Name: methyl 2-[[4-(prop-2-ynylamino)-2-(trifluoromethyl)phenyl]sulfonylamino]acetate CAS Name: 2-[[4-(prop-2-ynylamino)-2-(trifluoromethyl)phenyl]sulfonylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-(prop-2-ynylamino)-2-(trifluoromethyl)phenyl]sulfonylamino]acetate Traditional Name: 2-[[4-(propargylamino)-2-(trifluoromethyl)phenyl]sulfonylamino]acetic acid methyl ester Formula: C13H13F3N2O4S MolecularWeight: 350.31353

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNS(=O)(=O)C1=C(C=C(C=C1)NCC#C)C(F)(F)F

Isomeric SMILES

COC(=O)CNS(=O)(=O)C1=C(C=C(C=C1)NCC#C)C(F)(F)F

InChI

InChI=1S/C13H13F3N2O4S/c1-3-6-17-9-4-5-11(10(7-9)13(14,15)16)23(20,21)18-8-12(19)22-2/h1,4-5,7,17-18H,6,8H2,2H3